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Scine::Sparrow
3.1.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include "Sparrow/Implementations/Dftb/Utils/RepulsionParameters.h"#include "boost/optional.hpp"#include <array>#include <string>#include <unordered_map>

Go to the source code of this file.
Classes | |
| struct | Scine::Sparrow::dftb::SkfData |
| struct | Scine::Sparrow::dftb::SkfData::SameElementLine |
| struct | Scine::Sparrow::dftb::SkfSpinConstants |
| struct | Scine::Sparrow::dftb::SkfHubbardDerivatives |